SCHEMBL3140929

SCHEMBL3140929

CCCc1cc(C)c2cc(Oc3c(Br)cc(CCC(=O)O)cc3Br)cc(F)c2n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRA P10827 20/20 0.43
THRB P10828 20/20 0.43
ESR1 P03372 1/20 0.35
NR3C1 P04150 1/20 0.35
PGR P06401 1/20 0.35
NR3C2 P08235 1/20 0.35
AR P10275 1/20 0.35
PPARG P37231 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3145925 0.92 THRA (0.45) THRATHRBESR1NR3C1PGR
SCHEMBL3145653 0.90 THRA (0.48) THRATHRBESR1NR3C1PGR
SCHEMBL3127311 0.89 THRA (0.45) THRATHRBESR1NR3C1PGR
SCHEMBL3141230 0.89 THRA (0.41) THRATHRB
SCHEMBL3142284 0.86 THRB (0.34) THRATHRBPPARG
SCHEMBL3141250 0.86 THRA (0.37) THRATHRBPPARG
Propionic Acid SCHEMBL5074391 0.85 THRA (0.35) THRATHRBPPARG
SCHEMBL3145813 0.84 THRA (0.52) THRATHRBESR1NR3C1PGR
SCHEMBL5074394 0.81 THRA (0.32) THRATHRBPPARG
SCHEMBL3133494 0.78 THRA (0.38) THRATHRBPPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 US disclosed
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR THRA 4/4885THRB 6/4885ESR1 269/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.